Browsing by Author "Li, Yang"

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Citation - WoS: 11
Citation - Scopus: 12
Edge Dislocation Depinning From Hydrogen Atmosphere in Α-Iron
(Pergamon-Elsevier Science Ltd, 2024) Kapci, Mehmet Fazil; Yu, Ping; Marian, Jaime; Liu, Guisen; Shen, Yao; Li, Yang; Bal, Burak
Understanding the dislocation motion in hydrogen atmosphere is essential for revealing the hydrogen-related degradation in metallic materials. Atomic simulations were adopted to investigate the interaction between dislocations and hydrogen atoms, where the realistic hydrogen distribution in the vicinity of the dislocation core was emulated from the Grand Canonical Monte Carlo computations. The depinning of edge dislocations in alpha-Fe at different temperatures and hydrogen concentrations was then studied using Molecular Dynamics simulations. The results revealed that an increase in bulk hydrogen concentration increases the flow stress due to the pinning effect of solute hydrogen. The depinning stress was found to decrease due to the thermal activation of the edge dislocation at higher temperatures. In addition, prediction of the obtained results was performed by an elastic model that can correlate the bulk hydrogen concentration to depinning stress.
Citation - WoS: 1
Prediction of the Diffusible Hydrogen Concentration After Electrochemical Charging Utilizing Artificial Intelligence
(IOP Publishing Ltd, 2025) Sivesoglu, Abdurrahman; Li, Yang; Bal, Burak
The concentration of diffusible hydrogen in a material is of high importance as it helps to predict the hydrogen embrittlement effect in the material, and the amount of mechanical properties' degradation after reaching a critical concentration. Despite that, a simple experimental setup is not available to measure hydrogen concentration at service. In this paper, a multi-layer perceptron (MLP) model is developed using weight initialization, which can estimate the diffusible hydrogen concentration of Face-Centred-Cubic (FCC) metals after electrochemical charging. The input properties of the model include the electrochemical charging parameters of current density, temperature, and charging time as well as the grain size of the specimen. The MLP model with and without the weight initialization was validated and tested with unseen test dataset. The model in both cases showed an excellent predictive performance with a higher accuracy and faster convergence when using weight initialization. A linear correlation of 89% between the experimental and predicted hydrogen concentration was observed. This demonstrates that for the family of FCC metals under electrochemical charging, the estimation of diffusible hydrogen concentration is a feasible path for material safety design analysis.